盐酸地哌冬
TL;DR: 盐酸地哌冬 (CAS 537-12-2) is a chemical compound with molecular formula C22H28ClN3O4 and molecular weight 433.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
盐酸地哌冬
[2-(phenylcarbamoyloxy)-3-piperidin-1-ylpropyl] N-phenylcarbamate;hydrochloride
Also Known As: DIPERODON HYDROCHLORIDE, Proctodon, Diperodon HCl, Diperocaine, Diperodon (hydrochloride)
| Molecular Formula | C22H28ClN3O4 |
|---|---|
| Molecular Weight | 433.18 g/mol |
| LogP | 4.76 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 433.17682 |
| Heavy Atoms | 30 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 537-12-2 |
|---|---|
| SMILES | C1CCN(CC1)CC(COC(=O)NC2=CC=CC=C2)OC(=O)NC3=CC=CC=C3.Cl |
| InChIKey | OWULVAZDMWJBLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
盐酸地哌冬 (CAS 537-12-2), with molecular formula C22H28ClN3O4 and molecular weight 433.18 g/mol. IUPAC: [2-(phenylcarbamoyloxy)-3-piperidin-1-ylpropyl] N-phenylcarbamate;hydrochloride.
Chemical Property Profile of 盐酸地哌冬
Property Insights of 盐酸地哌冬
The XLogP value of 4.76 indicates that 盐酸地哌冬 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 盐酸地哌冬. Following Lipinski's Rule of Five, 盐酸地哌冬 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 盐酸地哌冬?
The CAS number of 盐酸地哌冬 is 537-12-2.
What is the molecular formula of 盐酸地哌冬?
The molecular formula of 盐酸地哌冬 is C22H28ClN3O4.
What is the molecular weight of 盐酸地哌冬?
The molecular weight of 盐酸地哌冬 is 433.18 g/mol.
Where can I buy 盐酸地哌冬?
You can request a quote for 盐酸地哌冬 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 盐酸地哌冬?
Yes, KEHONG BIO provides custom synthesis services for 盐酸地哌冬 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.